Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1104676 | 0.81 | CHRNB2 (0.39) | CHRNB2CHRNA4ALDH1A1CYP11B1CYP11B2 | |
| SCHEMBL3223184 | 0.81 | ALDH1A1 (0.44) | CHRNB2CHRNA4ALDH1A1GAAMAPT | |
| SCHEMBL15543388 | 0.80 | HTT (0.32) | CHRNB2CHRNA4 | |
| SCHEMBL1747710 | 0.77 | TSHR (0.44) | ALDH1A1GAAMAPT | |
| SCHEMBL29504068 | 0.77 | TSHR (0.44) | ALDH1A1GAAMAPT | |
| SCHEMBL10749522 | 0.76 | TSHR (0.33) | — | |
| SCHEMBL9255319 | 0.74 | TSHR (0.32) | ALDH1A1GAA | |
| SCHEMBL898931 | 0.72 | — | — | |
| SCHEMBL29429113 | 0.72 | — | — | |
| SCHEMBL899507 | 0.72 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0700903-B1 | PROCESS FOR PRODUCING CYANOPYRIDINE | IHARA CHEMICAL IND CO (JP) | 1997-11-12 | — | — | EP | disclosed |
| US-5675012-A | REACTING AMMONIUM HALIDE WITH TRICHLOROMETHYLPYRIDINE IN PRESENCE OF A COPPER AND ZINC COMPOUND | IHARA CHEMICAL INDUSTRY CO., LTD. (JP) | 1997-10-07 | — | — | US | disclosed |
| EP-0700903-A1 | PROCESS FOR PRODUCING CYANOPYRIDINE | IHARA CHEMICAL INDUSTRY CO., LTD. (JP) | 1996-03-13 | — | — | EP | disclosed |